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HS Code |
428557 |
| Iupac Name | 2,3,6,7-Tetrahydro-1H-1,4-diazepin-5(4H)-one |
| Molecular Formula | C5H10N2O |
| Molecular Weight | 114.15 g/mol |
| Cas Number | 6764-08-1 |
| Smiles | O=C1NCCNCC1 |
| Inchi | InChI=1S/C5H10N2O/c8-5-3-6-1-2-7-4-5/h6-7H,1-4H2 |
| Appearance | White to off-white solid |
| Melting Point | 170-173 °C |
| Boiling Point | Decomposes before boiling |
| Solubility In Water | Moderately soluble |
As an accredited 2,3,6,7-Tetrahydro-(1H)-1,4-Diazepin-5(4H)-One factory, we enforce strict quality protocols—every batch undergoes rigorous testing to ensure consistent efficacy and safety standards.
| Packing | The 2,3,6,7-Tetrahydro-(1H)-1,4-Diazepin-5(4H)-One is packaged in a 10g amber glass vial with a secure screw cap. |
| Shipping | **Shipping Description:** 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one should be shipped in a tightly sealed container, protected from moisture and direct sunlight. Depending on quantity and local regulations, it may require labeling as a chemical substance. Ship via standard or specialized couriers according to chemical transport guidelines. Handle with standard laboratory safety precautions. |
| Storage | Store 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one in a tightly sealed container, in a cool, dry, and well-ventilated area away from sources of ignition and incompatible substances such as strong oxidizers. Protect from moisture and direct sunlight. Suitable chemical-resistant labeling and secondary containment are recommended to prevent accidental release or contamination. Use proper personal protective equipment when handling. |
Applications of 2,3,6,7-Tetrahydro-(1H)-1,4-Diazepin-5(4H)-One in Industrial Manufacturing2,3,6,7-Tetrahydro-(1H)-1,4-Diazepin-5(4H)-One functions as a high-purity, specialty intermediate within several well-established segments of the chemical and pharmaceutical supply chain. Our manufacturing process ensures low residuals and batch-to-batch consistency, aligning with downstream integration needs for advanced active pharmaceutical ingredients, specialty agrochemicals, and fine chemical syntheses. Below, we outline key industrial application scenarios, specifically covering unique compliance requirements, recommended formulation ratios, critical process points, and finished product types for each sector. 1. Active Pharmaceutical Ingredient (API) Synthesis—CNS Drug IntermediatesMany pharmaceutical companies employ this compound as a ring-building scaffold in controlled synthesis of central nervous system (CNS) drug intermediates, especially for benzodiazepine derivatives. Its compatibility with hydrogenation and cyclization steps makes it suitable for high-value, low-volume pharmaceutical syntheses where strict impurity profiles are needed throughout multi-step routes, ensuring quality attributes required for registration dossiers. Industry compliance standards
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2. Advanced Agrochemical Intermediate ManufacturingThe diazepinone skeleton provides a platform for certain crop protection molecules, particularly as a building block in new insecticide and fungicide active ingredient research. Bulk agrochemical plants preferentially use this intermediate owing to its ring-strain configuration, which supports derivatives with improved field persistence and selectivity in modern pesticide R&D pipelines. Industry compliance standards
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3. Fine Chemical Synthesis—Specialty Polyamide and Polyurea AdditivesCustom formulators in the fine chemical sector incorporate this diazepinone as a nitrogen-rich heterocycle for introducing flexibility and specific reactivity to advanced polyamides and polyureas. Its ability to act as a chain extender and modify backbone polarity provides chemical manufacturers with means to fine-tune polymer mechanical properties, surface characteristics, and processing parameters for specialty end-uses. Industry compliance standards
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4. Research & Discovery Chemistry—Heterocyclic Scaffold LibrariesContract research organizations (CROs) and medicinal chemistry researchers routinely use this molecule to expand heterocyclic compound libraries for early-phase discovery. Its unique 1,4-diazepine ring forms the core of fragment-based drug scaffold expansions, supporting hit-to-lead campaigns for a broad spectrum of indication areas that demand synthetic novelty and patent-challenging architectures. Industry compliance standards
Typical usage ratio
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Competitive 2,3,6,7-Tetrahydro-(1H)-1,4-Diazepin-5(4H)-One prices that fit your budget—flexible terms and customized quotes for every order.
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Working hands-on with 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one brings us back to the basics of chemistry and shows us how solid craftsmanship matters just as much as technical knowledge. This isn’t a brand-new chemical or an industry novelty. Its ring structure speaks to those of us in production and application labs who have spent years watching syntheses rise and fall by small margins. With its seven-membered diazepine backbone, this intermediate has quietly shaped substance libraries across multiple research settings for decades. In our experience, the real story lies beyond the formula on the paper—it’s about consistency, reliability, and the value of experience.
Scaling up the synthesis of 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one requires more than theoretical know-how. In day-to-day manufacturing, the differences show at the drying stage, the cooling, the way the crystals look in a glass funnel under shop lights. The humidity in the plant can mean the difference between sharp, white crystalline powder and a lumpy off-color product that tells you to start over. For those of us at the vat or vacuum pump, doing the same steps each time doesn’t guarantee the same results—this is the chemical’s way of demanding attention. We have worked through more than one night shift correcting a low yield or chasing a tricky impurity that only shows up in scale. That’s the reality that sets apart a solid source of diazepine intermediates from a trader with no skin in the game.
We most frequently manufacture 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one in quantities from kilo to multi-ton scale. Purity generally starts from 98% by HPLC. That cutoff didn’t arise from marketing; it’s shaped by what the compound does downstream—each step after leaving our plant. Researchers using this material for heterocyclic scaffolds in pharmaceuticals or for specialty ligands in catalysis tell us that even a single percent of an unexpected byproduct can throw off a synthesis or an assay. The yellowing that can sometimes develop if raw material quality slips often signals higher levels of side products, and that triggers a stop in the workflow for anyone in a process development lab. As a result, we keep the color in check, controlling moisture under 0.5% where possible, and maintaining particle size for maximum processability.
Chemists and R&D teams relying on 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one need a material that behaves predictably at every stage. The molecule’s versatility lies not only in its diazepine ring, but also in the way it serves as a focus point for modifications. Medicinal chemists have reported successful attachment of varied side chains, while specialty polymer developers have taken advantage of the lactam functionality for unique crosslinkable resins. In both areas, off-target reactions are a persistent risk, so purity and batch verification prevent unplanned detours. This is one place where in-house manufacturing experience pays off; we routinely collaborate with clients to fine-tune crystallization or drying steps if their next process calls for slightly altered physical properties.
Comparisons often get made between our 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one and molecules like 1,4-diazepane or other diazepinone derivatives. In our plant and across our customer base, clear distinctions emerge. Tetrahydro-(1H)-1,4-diazepin-5(4H)-one offers heightened stability due to its partial hydrogenation, which sets it apart from more reactive or aromatic diazepine relatives. The presence of the 5-keto group increases its reactivity profile for subsequent chemical modifications, giving researchers a wider window for amide coupling and N-alkylation reactions. These differences have led to the compound being favored not just in bench-scale medicinal research but also in the late stages of scale-up, where mistakes become expensive and patience pays off.
Over the years, we have noticed how slight differences in manufacturing set our compound apart from others sold under similar names. The quickest signs come from solubility testing and MS spectra—the pure product dissolves cleanly, leaving little to no haze or precipitate unless moisture creeps in. Competing versions sometimes yield inconsistent behavior in dissolution, which can halt downstream reactions. This difference points back to the origins of the lot—whether the manufacturer truly controls every step, or simply resells from fluctuating third-party sources with loose oversight. Reliable synthesis of this compound does not lend itself to corner cutting. Controlled temperature ramps, careful aqueous workup, and tight batch records all matter. Our batches come out smoother not by chance, but by confronting and correcting failed runs with a willingness to experiment and improve.
Diazepinones of this class remain a workhorse in pharmaceutical research, especially as starting points for kinase inhibitors and other enzyme modulators. Many synthetic chemists share the same feedback: the integrity of the backbone saves hours of troubleshooting when exploring new derivatives. In polymer labs, the lactam functional group gets seized on as a crosslinking site, and careful control of reaction conditions—something only possible with a high-purity, well-characterized base—produces end-use properties like improved toughness or thermal resistance.
Another major driver is the surge in heterocyclic-building-block demand from specialty research shops, CROs, and in-house pharma teams. We field frequent requests for tailored modifications and continue to adapt fermentation and synthetic approaches to fit. This is one of those products where open communication between production and user makes a tangible difference. We see less time lost to batch failures and unforeseen process hiccups where supply comes from a manufacturer who understands the product’s quirks, rather than a purely logistical outfit.
Making a molecule like tetrahydro-diazepinone means dealing with issues on the ground. Forgetting to check an incoming precursor’s water content has ruined a batch more than once, teaching us to audit every new lot. A leaky valve, a heating block one degree too high—these seem like small details, but they become costly surprises in plant-scale work. Each successful batch in our facility is built on the memory of every mistake we’ve recovered from, and the incremental improvements that followed: refining the extraction pH, swapping out tubing, trialing new drying protocols to prevent contamination, or retooling an entire workup to prevent byproduct formation.
We keep our standards sharp because we’ve seen the costs of complacency. Every batch heads to QC for HPLC, NMR, and moisture testing, but those machines don’t tell the whole story. Severely off-color material—something that doesn’t show up by HPLC—alerts us right away. Early batches years ago taught us to trust the process, but also always verify by eye and by feel. Crystalline structure, flow properties, ease of transfer—these matter when shipping kilos instead of grams. Dust control in the plant, effective vacuum controls, and efficient solid handling all play into delivering a product that meets researchers’ expectations. Our own in-lab staff often run side-by-side syntheses using both our product and outside alternatives and log the results—yield, purity, ease of workup. This gives us firsthand evidence of the differences and allows feedback to cycle continuously back into production.
People outside batch production rarely see the way supply stability links directly to plant-level attention. Broad availability of a diazepinone on the open market means little if months-long gaps punctuate supply. We invest in redundant sourcing of key precursors and keep safety stocks onsite. It’s a decision that limits quarterly profits, but pays off in reliability for the end customer—especially when their project schedule depends on predictable delivery of critical intermediates. These decisions stem from a deep understanding of not just chemistry, but also the real-world needs of those who work with such compounds day after day.
Another key point lies in regulatory and documentation expectations, which have gotten stricter with increased pharmaceutical and specialty chemical scrutiny worldwide. Maintaining detailed batch histories, impurity profiles, and fulfillment records requires more effort than some distributors understand. Consistent documentation makes a practical difference: customs clearance, regulatory submissions, and patent workups all move quicker with clean, complete data. This is an area where doing the core work pays off—those who only buy and flip stock rarely manage long-term documentation cleanly. Our multi-year logs help manufacturing customers solve downstream problems and speed up technical discussions when issues do arise.
Time in large-scale manufacturing reveals insights that bench-only research never spots. For example, our chemists have observed that the product’s sensitivity to ambient moisture influences not just drying but also long-term storage stability. This influences our packaging design and guides users in choosing storage conditions that extend shelf life. Conversations with end users have led us to adjust even minor aspects—such as particle size range or improving re-sealable packaging—to result in more convenient everyday handling in R&D settings. These increments can mean the difference between an R&D lab hitting a deadline or putting a project on hold.
In commercialization, the need for scale consistency puts particular pressure on manufacturing sources. Any deviation from the reference standard in a customer’s workflow may require a lengthy revalidation or spec adjustment. And for pharmaceutical companies or synthetic chemistry teams facing regulatory audits, the expertise of the original manufacturer—someone equipped to issue full C of A details, trace impurities, and retest historical batches—can mean faster answers, smoother audits, and simpler troubleshooting. Real accountability comes when every problem encountered in our own plant leads to a fix, not just an excuse.
Based on direct user feedback and challenges faced in both traditional and emerging applications, we have worked to upgrade our filtration setups, improve waste solvent recycling, and minimize the environmental footprint of each run. In an era with rising expectations for greener chemistry and tighter regulatory environments, our drive comes from the experience of solving headaches as they appear. A patchwork operation might make a batch or two, but only consistent, hands-on process optimization delivers product that meets specification every time and stands up to evolving standards.
In product innovation, our in-house development team keeps its footing in reality by launching pilot projects for new process variants. This has included alternate hydrogenation and reductive amination methods, as well as developing derivatives based on market requests. Our integration of new reactor controls and digital monitoring means problems get caught earlier, and learning accelerates with each run. Keeping open channels with both suppliers and buyers—something a direct manufacturer can easily do—yields tangible improvements, like lowering impurities by a tenth of a percent or shifting to less hazardous solvents without sacrificing yield.
The most gratifying feedback we get is from customers who find that their syntheses, crystallizations, and downstream modifications just work better with a consistently made compound. Pharmaceutical researchers mention avoiding weeks of troubleshooting thanks to clean product. Polymer scientists have built pilot lines on the strength of repeated, on-spec intermediate deliveries. These results aren’t achieved through luck. Daily improvement, hands-on oversight, and listening to those who use our product shape everything from our procurement policies to our drying protocols.
2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one stands as a testament to what manufacturing skill and ongoing commitment can achieve. Our narrative isn’t just about chemistry—it’s about reliability and trust built batch by batch, grounded by every lesson learned between reactor and customer lab. For manufacturers like us, the story isn’t only the structure on paper. It’s the steady rhythm of synthesis, the eyes-on checks, the collaboration with people putting molecules to work in the real world, and the drive to raise the bar every time.